SCHEMBL8896993

SCHEMBL8896993

CCc1c(OCc2ccccc2)ccc(C(=O)O)c1-c1cccc(C)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.47
LRRK2 Q5S007 1/20 0.46
MRGPRX4 Q96LA9 5/20 0.46
PTGER1 P34995 4/20 0.46
FOLH1 Q04609 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
MAPT P10636 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
FFAR4 Q5NUL3 1/20 0.43
FFAR1 O14842 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
CTSV O60911 1/20 0.42
CTSL P07711 1/20 0.42
PTGER4 P35408 1/20 0.42
PTGER3 P43115 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL851497 0.76 L3MBTL1 (0.60) MCL1MRGPRX4PTGER1FOLH1L3MBTL1
SCHEMBL4381582 0.76 LRRK2 (0.41) LRRK2MRGPRX4PTGER1SMN1; SMN2FFAR4
SCHEMBL3701442 0.76 PTGER1 (0.60) MCL1MRGPRX4PTGER1FOLH1L3MBTL1
SCHEMBL4389711 0.75 CYP4F2 (0.41) LRRK2MRGPRX4PTGER1L3MBTL1MAPT
SCHEMBL1647381 0.75 FOLH1 (0.67) MCL1LRRK2MRGPRX4PTGER1FOLH1
SCHEMBL8168015 0.75 MCL1 (0.64) MCL1LRRK2MRGPRX4PTGER1FOLH1
SCHEMBL4385840 0.74 MAPT (0.39) LRRK2MRGPRX4PTGER1L3MBTL1MAPT
SCHEMBL4403623 0.74 FOLH1 (0.51) MCL1MRGPRX4PTGER1FOLH1L3MBTL1
SCHEMBL28093635 0.73 PTGER1 (0.59) MCL1PTGER1FOLH1L3MBTL1MAPT
SCHEMBL17736805 0.73 MCL1 (0.47) MCL1LRRK2MRGPRX4PTGER1FOLH1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1997027173-A2 DIHALOPROPENE COMPOUNDS, THEIR USE AS INSECTICIDES/ACARICIDES AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-31 WO disclosed